| SpectraBase Compound ID | K9aMmtVn7M7 |
|---|---|
| InChI | InChI=1S/C58H94O26/c1-24-34(64)45(83-49-41(71)38(68)44(30(20-60)79-49)82-48-40(70)37(67)43(29(19-59)78-48)81-47-39(69)35(65)27(62)21-75-47)42(72)50(77-24)84-46-36(66)28(63)22-76-51(46)80-33-11-12-54(4)31(55(33,5)23-61)10-13-57(7)32(54)9-8-25-26-18-53(2,3)14-16-58(26,52(73)74)17-15-56(25,57)6/h8,24,26-51,59-72H,9-23H2,1-7H3,(H,73,74)/t24-,26?,27+,28-,29-,30+,31?,32?,33-,34-,35-,36-,37-,38+,39+,40-,41+,42+,43-,44+,45+,46+,47-,48-,49-,50+,51+,54-,55-,56+,57+,58-/m0/s1 |
| InChIKey | VPIKFTXSQHVPSK-ZTDVKUFGSA-N |
| Mol Weight | 1207.4 g/mol |
| Molecular Formula | C58H94O26 |
| Exact Mass | 1206.603333 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JKjTZqdcvAn |
|---|---|
| Name | HEDERAGENIN-3-O-BETA-D-XYLOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSIDE |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C58H94O26 |
| InChI | InChI=1S/C58H94O26/c1-24-34(64)45(83-49-41(71)38(68)44(30(20-60)79-49)82-48-40(70)37(67)43(29(19-59)78-48)81-47-39(69)35(65)27(62)21-75-47)42(72)50(77-24)84-46-36(66)28(63)22-76-51(46)80-33-11-12-54(4)31(55(33,5)23-61)10-13-57(7)32(54)9-8-25-26-18-53(2,3)14-16-58(26,52(73)74)17-15-56(25,57)6/h8,24,26-51,59-72H,9-23H2,1-7H3,(H,73,74)/t24-,26?,27+,28-,29-,30+,31?,32?,33-,34-,35-,36-,37-,38+,39+,40-,41+,42+,43-,44+,45+,46+,47-,48-,49-,50+,51+,54-,55-,56+,57+,58-/m0/s1 |
| InChIKey | VPIKFTXSQHVPSK-ZTDVKUFGSA-N |
| Literature Reference Author | K.Y.JUNG,J.C.DO,K.H.SON |
| Literature Reference Citation | J.NAT.PROD.,56,1912(1993) |
| Literature Reference DOI | 10.1021/np50101a007 |
| Molecular Weight | 1207.369 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCS5173 |